A proposal for the proper use of pseudopotentials in molecular orbital cluster model studies of chemisorption
- Paul S. Bagus
- Charles W. Bauschlicher Jr.
- et al.
- 1984
- The Journal of Chemical Physics
Publications
954 results at The Journal of Chemical Physics
Quantum Monte Carlo calculation of the singlet-triplet splitting in methylene
- Peter J. Reynolds
- Michel Dupuis
- et al.
- 1984
- The Journal of Chemical Physics
Rotational and electronic relaxation in pulsed supersonic beams of NO seeded in He and Ar
- H. Zacharias
- M.M.T. Loy
- et al.
- 1984
- The Journal of Chemical Physics
The onset of elastic coupling in polymer liquids
- A. Baumgärtner
- G. Ronca
- 1984
- The Journal of Chemical Physics
Second harmonic generation at thin film silver electrodes via surface polaritons
- Robert M. Corn
- Marco Romagnoli
- et al.
- 1984
- The Journal of Chemical Physics
Surface plasmon-enhanced Raman scattering at thin silver films
- Robert M. Corn
- Michael R. Philpott
- 1984
- The Journal of Chemical Physics
Second row homopolar diatomic molecules. Potential curves, spectroscopic constants, and dissociation energies at the basis set limit for SCF and limited CI wave functions
- A.D. McLean
- B. Liu
- et al.
- 1984
- The Journal of Chemical Physics
Studies of solvated ion motion: Molecular dynamics results for dilute aqueous solutions of alkali and halide ions
- H.L. Nguyen
- S.A. Adelman
- 1984
- The Journal of Chemical Physics
NiNO. A model for NO on a metal surface
- Charles W. Bauschlicher Jr.
- Paul S. Bagus
- 1984
- The Journal of Chemical Physics
The interpretation of very low frequency Raman scattering from roughened silver electrodes: Clusters, cavities, or complexes?
- Robert M. Corn
- Michael R. Philpott
- 1984
- The Journal of Chemical Physics